SCHEMBL30150750

SCHEMBL30150750

O=P([O-])([O-])OC[C@H]1O[C@@H](n2cnc3c(NC4CCCC4)ncnc32)[C@H](O)[C@@H]1O.[Na+].[Na+]

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA1 known ✓ P30542 8/20 1.00
▸ ADORA3 known ✓ P0DMS8 7/20 0.77
▸ ADORA2A known ✓ P29274 5/20 0.77
▸ ADORA2B known ✓ P29275 3/20 0.75
▸ TAS1R3 Q7RTX0 1/20 0.85
▸ TAS1R1 Q7RTX1 1/20 0.85
▸ GPR17 Q13304 1/20 0.77
▸ TSHR P16473 2/20 0.72
▸ PMP22 Q01453 2/20 0.72
▸ GAA P10253 1/20 0.72
▸ HTT P42858 1/20 0.72
▸ SIGMAR1 Q99720 1/20 0.72
▸ SLC29A1 Q99808 1/20 0.72
▸ RXFP1 Q9HBX9 1/20 0.72
▸ MEN1 O00255 1/20 0.72
▸ KMT2A Q03164 1/20 0.72
▸ TP53 P04637 1/20 0.72
▸ NFKB1 P19838 1/20 0.72
▸ HIF1A Q16665 1/20 0.72
▸ SMN1; SMN2 Q16637 1/20 0.70

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL20277517 0.92 TAS1R3 (1.00) ADORA1TAS1R3TAS1R1GPR17ADORA3
SCHEMBL20282632 0.92 TAS1R3 (1.00) ADORA1TAS1R3TAS1R1GPR17ADORA3
SCHEMBL20282633 0.92 TAS1R3 (1.00) ADORA1TAS1R3TAS1R1GPR17ADORA3
SCHEMBL30969949 0.92 TAS1R3 (1.00) ADORA1TAS1R3TAS1R1GPR17ADORA3
SCHEMBL30969947 0.92 TAS1R3 (1.00) ADORA1TAS1R3TAS1R1GPR17ADORA3
SCHEMBL17824354 0.92 TAS1R3 (1.00) ADORA1TAS1R3TAS1R1GPR17ADORA3
SCHEMBL17023381 0.90 ADORA1 (1.00) ADORA1TAS1R3TAS1R1GPR17ADORA3
SCHEMBL17023380 0.90 ADORA1 (1.00) ADORA1TAS1R3TAS1R1GPR17ADORA3
SCHEMBL23440052 0.89 GPR17 (0.97) ADORA1TAS1R3TAS1R1GPR17ADORA3
SCHEMBL22866623 0.89 TAS1R3 (0.84) ADORA1TAS1R3TAS1R1GPR17ADORA3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250359548-A1 METHODS OF IMPROVING STRESS TOLERANCE, GROWTH AND YIELD IN PLANTS VALENT BIOSCIENCES LLC (US) 2025-11-27 — — US disclosed
US-12402623-B2 Methods of improving stress tolerance, growth and yield in plants VALENT BIOSCIENCES LLC (US) 2025-09-02 — — US disclosed
US-20240057597-A1 METHODS OF IMPROVING STRESS TOLERANCE, GROWTH AND YIELD IN PLANTS VALENT BIOSCIENCES LLC (US) 2024-02-22 — — US disclosed
US-11812745-B2 Method of improving stress tolerance, growth and yield in plants VALENT BIOSCIENCES LLC (US) 2023-11-14 — — US disclosed
EP-4106523-A1 METHODS OF IMPROVING STRESS TOLERANCE, GROWTH AND YIELD IN PLANTS Valent BioSciences LLC (US) 2022-12-28 — — EP disclosed
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